%chk=000066535.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066535

0 1
 P    3.277800       1.434000      0.6053000    
 O  -5.8600001E-02  -1.791300     -0.9800000    
 O    2.854800     -7.7500001E-02  0.2286000    
 O    1.596000      0.5810000      -2.124400    
 O    1.030300      -4.102900      0.2077000    
 O    4.875300       1.341300      0.8394000    
 O    2.691500       1.601100       2.103100    
 O   -2.477100       1.313400      -2.113600    
 O    2.832100       2.483400     -0.3706000    
 N   -1.582300     -8.7200001E-02 -0.5125000    
 N   -3.664500       1.089800     -0.1921000    
 N   -4.875400      0.8577000       1.779700    
 C    1.480100     -0.3739000      0.1072000    
 C   0.7804000      0.4397000     -0.9633000    
 C    1.242200      -1.797500     -0.3674000    
 C  -0.4236000     -0.4337000      -1.291200    
 C    1.272700      -2.819200      0.7558000    
 C   -1.726200     -0.6416000      0.7500000    
 C   -2.575200      0.8017000     -0.9968000    
 C   -2.765300     -0.3765000       1.539300    
 C   -3.785100      0.5580000      0.9959000    
 H    1.004200     -0.2073000       1.079500    
 H   0.4960000       1.443500     -0.6336000    
 H    1.963600      -2.087300      -1.142100    
 H  -0.6735000     -0.3908000      -2.357100    
 H   0.5187000      -2.640400       1.523800    
 H    2.257300      -2.828700       1.234700    
 H    2.400700       1.060100      -1.866900    
 H  -0.9765000      -1.314900       1.121500    
 H    1.075700      -4.741200      0.9399000    
 H   -2.884300     -0.8050000       2.525500    
 H    5.375900       2.163800       1.026300    
 H    2.735000       2.481000       2.534300    
 H   -4.997700      0.4609000       2.705500    
 H   -5.596000       1.490300       1.449100    


%chk=000066535-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066535

0 1
P 3.510325 1.544051 0.472452
O -0.043832 -1.818506 -0.779217
O 2.897292 -0.048237 0.498796
O 1.518051 0.538776 -2.019960
O 1.613507 -4.131350 0.222438
O 5.140908 1.274404 0.891951
O 2.874395 2.169472 1.927419
O -1.827228 1.898852 -1.447456
O 3.262344 2.404877 -0.846986
N -1.689234 -0.130111 -0.283813
N -3.508513 1.426882 0.132415
N -5.160167 0.914687 1.678442
C 1.456701 -0.327162 0.308461
C 0.724991 0.480882 -0.806989
C 1.331648 -1.777156 -0.196472
C -0.475087 -0.456346 -1.105866
C 1.490599 -2.831030 0.887075
C -2.229548 -1.031179 0.605611
C -2.354140 1.145052 -0.578295
C -3.388611 -0.736246 1.299297
C -4.005860 0.543730 1.026327
H 0.950408 -0.180303 1.282212
H 0.388251 1.479317 -0.479949
H 2.063966 -1.949205 -1.005916
H -0.738937 -0.374251 -2.172641
H 0.615785 -2.801810 1.572689
H 2.409657 -2.584239 1.462130
H 2.110386 1.343130 -1.971358
H -1.699483 -1.982028 0.696229
H 1.757224 -4.838021 0.900522
H -3.817002 -1.456246 1.999159
H 5.744731 1.095272 0.126349
H 2.957073 3.149856 2.045569
H -5.612095 0.311139 2.359407
H -5.569506 1.816849 1.440467


